MOLPRO Basis Query, element=Es, basis=cc-pVQZ-X2C, l=p
Basis Es p cc-pVQZ-X2C
| Primitives | Contractions... |
|---|
| 78546265.000000 | 0.000015 | -0.000019 | 0.000001 | -0.000003 | 0.000001 | -0.000000 | -0.000001 | 0.000002 | 0.000002 | -0.000002 | 0.000000 |
| 30346600.000000 | 0.000006 | -0.000007 | 0.000000 | -0.000001 | 0.000000 | -0.000000 | -0.000000 | 0.000001 | 0.000001 | -0.000001 | 0.000000 |
| 11777413.000000 | 0.000041 | -0.000051 | 0.000003 | -0.000008 | 0.000003 | -0.000001 | -0.000003 | 0.000004 | 0.000006 | -0.000006 | 0.000000 |
| 4755841.200000 | 0.000051 | -0.000064 | 0.000003 | -0.000009 | 0.000004 | -0.000001 | -0.000003 | 0.000005 | 0.000007 | -0.000008 | 0.000000 |
| 1986038.700000 | 0.000128 | -0.000162 | 0.000008 | -0.000024 | 0.000011 | -0.000002 | -0.000008 | 0.000013 | 0.000018 | -0.000020 | 0.000000 |
| 853837.010000 | 0.000220 | -0.000279 | 0.000015 | -0.000041 | 0.000018 | -0.000004 | -0.000014 | 0.000022 | 0.000031 | -0.000036 | 0.000000 |
| 376095.320000 | 0.000462 | -0.000586 | 0.000031 | -0.000087 | 0.000038 | -0.000008 | -0.000031 | 0.000046 | 0.000066 | -0.000073 | 0.000000 |
| 169348.350000 | 0.000883 | -0.001123 | 0.000060 | -0.000167 | 0.000074 | -0.000016 | -0.000058 | 0.000088 | 0.000127 | -0.000146 | 0.000000 |
| 77932.763000 | 0.001806 | -0.002304 | 0.000123 | -0.000343 | 0.000151 | -0.000032 | -0.000120 | 0.000182 | 0.000260 | -0.000284 | 0.000000 |
| 36672.291000 | 0.003645 | -0.004671 | 0.000255 | -0.000698 | 0.000308 | -0.000065 | -0.000244 | 0.000368 | 0.000533 | -0.000619 | 0.000000 |
| 17653.710000 | 0.007602 | -0.009799 | 0.000547 | -0.001469 | 0.000648 | -0.000138 | -0.000516 | 0.000780 | 0.001112 | -0.001201 | 0.000000 |
| 8703.113700 | 0.015862 | -0.020639 | 0.001196 | -0.003118 | 0.001375 | -0.000292 | -0.001092 | 0.001641 | 0.002388 | -0.002815 | 0.000000 |
| 4401.317400 | 0.032917 | -0.043402 | 0.002635 | -0.006619 | 0.002918 | -0.000620 | -0.002329 | 0.003519 | 0.005001 | -0.005306 | 0.000000 |
| 2286.873300 | 0.065124 | -0.087676 | 0.005731 | -0.013593 | 0.005993 | -0.001274 | -0.004754 | 0.007143 | 0.010448 | -0.012578 | 0.000000 |
| 1220.617200 | 0.117206 | -0.162237 | 0.011544 | -0.025643 | 0.011303 | -0.002402 | -0.009037 | 0.013684 | 0.019323 | -0.019790 | 0.000000 |
| 667.813790 | 0.178250 | -0.255208 | 0.020113 | -0.041420 | 0.018260 | -0.003881 | -0.014445 | 0.021640 | 0.032129 | -0.040948 | 0.000000 |
| 373.652590 | 0.208760 | -0.292643 | 0.021212 | -0.046385 | 0.020435 | -0.004343 | -0.016488 | 0.025187 | 0.034147 | -0.027656 | 0.000000 |
| 212.631980 | 0.183135 | -0.140406 | -0.019629 | -0.005671 | 0.002494 | -0.000523 | -0.001435 | 0.001307 | 0.006048 | -0.029585 | 0.000000 |
| 122.625610 | 0.163022 | 0.221638 | -0.141481 | 0.107333 | -0.047610 | 0.010159 | 0.037286 | -0.055362 | -0.091453 | 0.154976 | 0.000000 |
| 72.207952 | 0.180609 | 0.511778 | -0.283576 | 0.227661 | -0.101243 | 0.021616 | 0.083756 | -0.131777 | -0.179608 | 0.120613 | 0.000000 |
| 42.660604 | 0.129544 | 0.372464 | -0.145554 | 0.115015 | -0.049847 | 0.010586 | 0.035246 | -0.045257 | -0.092217 | 0.267705 | 0.000000 |
| 25.077165 | 0.037111 | 0.014922 | 0.305956 | -0.245791 | 0.117025 | -0.025361 | -0.091348 | 0.139119 | 0.312833 | -0.775623 | 0.000000 |
| 14.967258 | 0.000405 | -0.153927 | 0.573231 | -0.558141 | 0.276690 | -0.060187 | -0.243812 | 0.397643 | 0.466665 | 0.135912 | 0.000000 |
| 8.915151 | -0.001353 | -0.087416 | 0.314075 | -0.208702 | 0.082809 | -0.017504 | -0.037713 | 0.010779 | 0.204389 | -1.402160 | 0.000000 |
| 5.226751 | -0.000216 | -0.013211 | 0.054512 | 0.475448 | -0.319965 | 0.073005 | 0.258346 | -0.433104 | -1.478460 | 4.945930 | 0.000000 |
| 3.013358 | 0.000203 | 0.003191 | 0.000012 | 0.584869 | -0.429657 | 0.101095 | 0.505416 | -0.984700 | -0.869842 | -4.604190 | 0.000000 |
| 1.693207 | 0.000061 | 0.001253 | -0.000769 | 0.222975 | -0.056486 | 0.008088 | -0.158692 | 1.000210 | 3.813220 | -0.948727 | 0.000000 |
| 0.913102 | 0.000018 | 0.000284 | -0.000203 | 0.037641 | 0.401729 | -0.112647 | -0.762426 | 1.215190 | -2.117870 | 5.691720 | 0.000000 |
| 0.483382 | -0.000001 | 0.000013 | 0.000035 | 0.016349 | 0.509077 | -0.166899 | -0.198618 | -1.002040 | -1.534750 | -5.445500 | 0.000000 |
| 0.250763 | 0.000003 | 0.000039 | -0.000002 | 0.007481 | 0.260683 | -0.121734 | 0.357820 | -0.938128 | 2.023600 | 1.755360 | 0.000000 |
| 0.118495 | -0.000001 | -0.000007 | 0.000011 | 0.001251 | 0.044081 | 0.122931 | 0.559952 | 0.583699 | 0.019858 | 1.149170 | 0.000000 |
| 0.057473 | 0.000000 | 0.000005 | -0.000003 | -0.000004 | 0.001249 | 0.456676 | 0.239206 | 0.519087 | -0.722870 | -1.075270 | 0.000000 |
| 0.027876 | -0.000000 | -0.000002 | 0.000002 | 0.000045 | 0.001239 | 0.455801 | 0.024787 | 0.031230 | -0.029435 | -0.042669 | 0.000000 |
| 0.013502 | 0.000000 | 0.000001 | -0.000001 | -0.000010 | -0.000229 | 0.120064 | 0.000169 | 0.005848 | -0.012970 | -0.024505 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)
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